2-Amino-3-(methylsulfanyl)propan-1-ol
Basic information
- CAS
69977-56-6- Standard SMILES
CSCC(N)CO- InChIKey
AWGBRLHYONGEEL-UHFFFAOYSA-N- Molecular formula
- C4H11NOS
- Average molar mass
- 121.2 g/mol
- Monoisotopic mass
- 121.05613515
Overview
See also: (2R)-2-amino-3-(methylsulfanyl)propan-1-ol (annotation moved to).
Names & identifiers
- Preferred name
- 2-Amino-3-(methylsulfanyl)propan-1-ol
- IUPAC
- 2-amino-3-methylsulfanylpropan-1-ol
Names & synonyms
2-amino-3-(methylthio)propan-1-ol2-Amino-3-(methylsulfanyl)propan-1-ol160022-92-42-amino-3-methylsulfanylpropan-1-ol69977-56-6(R)-2-amino-3-(methylthio)propan-1-olNSC308561SCHEMBL2555319DTXSID50316880AKOS014134878NSC-308561G90618
Show more names
EN300-1250461F8883-8043
Database identifiers
- CAS
69977-56-6- PubChem CID
- 328698
- DTXSID
DTXSID50316880- Nikkaji
- J1.102.395I
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 42.7
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Related reactions
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Compound notes
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